San Francisco / Bronx / Valencia / New York / Kyoto / College Station / /
Company
AMP / Data Bank / GE / Ligand / Protein Chemistry Laboratory / Amax / DELPHI / Storoni L. C. / Gene Technology Laboratory / Brookhaven National Laboratory / J. Comp / Tyler / MTI / /
Country
United States / /
Currency
pence / / /
Facility
Texas A&M University / Ullmann Building / Protein Chemistry Laboratory / Tm0936-SIH complex / Albert Einstein College of Medicine / University of California / Gene Technology Laboratory of Texas A&M University / Zn complex / /
IndustryTerm
high-energy structures / active site / high-energy structure / high-energy intermediate structure / chemical libraries / The chemical identities / metal ion / metal content / online version / high-energy intermediate structures / homocysteine product / biological systems / Metal analysis / ground state product / enzyme active site / high-energy intermediates / software suite / metal-ligating residues / search model / charged phosphate / high-energy intermediate / free thiol / high-energy intermediate forms / divalent metal ion / high-energy forms / high energy centre / high-energy / grid-based energy evaluation / desolvation energy / model binding site / high-energy intermediate geometries / enzyme solution / reservoir solution / active site metal ion / high-energy intermediate form / /
Organization
Department of Pharmaceutical Chemistry / Joint Center for Structural Genomics / Robert A. Welch Foundation / AHS / Albert Einstein College of Medicine / Texas A&M University / University of California / San Francisco / /
Person
Irwin / V / Mohan / V / Tantillo / /
Position
Author Information The / Author / /
Product
Cl / adenosine / /
ProgrammingLanguage
ADA / Adenine / /
ProvinceOrState
Texas / North Dakota / New York / South Carolina / California / /
Technology
bioinformatics / X-ray / cloning / ion exchange / chemical libraries / drug discovery / structural genomics / dielectric / DNA sequencing / spectroscopy / /
Vol 448 | 16 August 2007 | doi:[removed]nature05981 ARTICLES Structure-based activity prediction for an enzyme of unknown function Johannes C. Hermann1, Ricardo Marti-Arbona2, Alexander A. Fedorov3, Elena Fedorov3, Steve